Tuesday, February 26, 2013

All Chemical Compounds Information




Product OPENEYE NAME: N-(cyclopentylcarbamoyl)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]acetamide
CAS Name: N-[(cyclopentylamino)-oxomethyl]-2-[4-(2,4-dimethylphenyl)sulfonyl-1-piperazin-1-iumyl]acetamide
IUPAC NAME: N-(cyclopentylcarbamoyl)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]acetamide
SYSTEMATIC NAME: N-(cyclopentylcarbamoyl)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]ethanamide
MOLECULAR FORMULA: C20H31N4O4S+
MOLECULAR WEIGHT: 423.54954
SMILES: CC1=CC(=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NC(=O)NC3CCCC3)C
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Product OPENEYE NAME: N-(cyclopentylcarbamoyl)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]acetamide
CAS Name: N-[(cyclopentylamino)-oxomethyl]-2-[4-(2,4-dimethylphenyl)sulfonyl-1-piperazinyl]acetamide
IUPAC NAME: N-(cyclopentylcarbamoyl)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]acetamide
SYSTEMATIC NAME: N-(cyclopentylcarbamoyl)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]ethanamide
MOLECULAR FORMULA: C20H30N4O4S
MOLECULAR WEIGHT: 422.5416
SMILES: CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC(=O)NC3CCCC3)C
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Product OPENEYE NAME: (2S)-2-(4-acetyl-2-methoxy-phenoxy)-N-(3,4-difluorophenyl)propanamide
CAS Name: (2S)-2-(4-acetyl-2-methoxyphenoxy)-N-(3,4-difluorophenyl)propanamide
IUPAC NAME: (2S)-2-(4-acetyl-2-methoxyphenoxy)-N-(3,4-difluorophenyl)propanamide
SYSTEMATIC NAME: (2S)-N-[3,4-bis(fluoranyl)phenyl]-2-(4-ethanoyl-2-methoxy-phenoxy)propanamide
MOLECULAR FORMULA: C18H17F2NO4
MOLECULAR WEIGHT: 349.328686
SMILES: C[C@@H](C(=O)NC1=CC(=C(C=C1)F)F)OC2=C(C=C(C=C2)C(=O)C)OC
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Product OPENEYE NAME: N-[(3S)-1,1-dioxothiolan-3-yl]-N-methyl-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-acetamide
CAS Name: N-[(3S)-1,1-dioxo-3-thiolanyl]-N-methyl-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]acetamide
IUPAC NAME: N-[(3S)-1,1-dioxothiolan-3-yl]-N-methyl-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylacetamide
SYSTEMATIC NAME: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-methyl-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-ethanamide
MOLECULAR FORMULA: C18H21N3O3S2
MOLECULAR WEIGHT: 391.50764
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)N(C)[C@H]3CCS(=O)(=O)C3
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Product OPENEYE NAME: [3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 6-methyl-4-oxo-chromene-2-carboxylate
CAS Name: 6-methyl-4-oxo-1-benzopyran-2-carboxylic acid [3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl ester
IUPAC NAME: [3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 6-methyl-4-oxochromene-2-carboxylate
SYSTEMATIC NAME: [3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 6-methyl-4-oxidanylidene-chromene-2-carboxylate
MOLECULAR FORMULA: C21H16N2O6
MOLECULAR WEIGHT: 392.36154
SMILES: CC1=CC2=C(C=C1)OC(=CC2=O)C(=O)OCC3=NC(=NO3)C4=CC(=CC=C4)OC
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Product OPENEYE NAME: ethyl N-[2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]acetyl]carbamate
CAS Name: N-[2-[4-(2,4-dimethylphenyl)sulfonyl-1-piperazin-1-iumyl]-1-oxoethyl]carbamic acid ethyl ester
IUPAC NAME: ethyl N-[2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]acetyl]carbamate
SYSTEMATIC NAME: ethyl N-[2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]ethanoyl]carbamate
MOLECULAR FORMULA: C17H26N3O5S+
MOLECULAR WEIGHT: 384.47044
SMILES: CCOC(=O)NC(=O)C[NH+]1CCN(CC1)S(=O)(=O)C2=C(C=C(C=C2)C)C
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Product OPENEYE NAME: ethyl N-[2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]acetyl]carbamate
CAS Name: N-[2-[4-(2,4-dimethylphenyl)sulfonyl-1-piperazinyl]-1-oxoethyl]carbamic acid ethyl ester
IUPAC NAME: ethyl N-[2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]acetyl]carbamate
SYSTEMATIC NAME: ethyl N-[2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]ethanoyl]carbamate
MOLECULAR FORMULA: C17H25N3O5S
MOLECULAR WEIGHT: 383.4625
SMILES: CCOC(=O)NC(=O)CN1CCN(CC1)S(=O)(=O)C2=C(C=C(C=C2)C)C
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Product OPENEYE NAME: N-(2-furylmethylcarbamoyl)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-acetamide
CAS Name: N-[(2-furanylmethylamino)-oxomethyl]-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]acetamide
IUPAC NAME: N-(furan-2-ylmethylcarbamoyl)-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylacetamide
SYSTEMATIC NAME: N-(furan-2-ylmethylcarbamoyl)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-ethanamide
MOLECULAR FORMULA: C19H18N4O3S
MOLECULAR WEIGHT: 382.43622
SMILES: CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC(=O)NC(=O)NCC3=CC=CO3
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Product OPENEYE NAME: (2R)-2-(4-acetyl-2-methoxy-phenoxy)-N-(3,4-difluorophenyl)propanamide
CAS Name: (2R)-2-(4-acetyl-2-methoxyphenoxy)-N-(3,4-difluorophenyl)propanamide
IUPAC NAME: (2R)-2-(4-acetyl-2-methoxyphenoxy)-N-(3,4-difluorophenyl)propanamide
SYSTEMATIC NAME: (2R)-N-[3,4-bis(fluoranyl)phenyl]-2-(4-ethanoyl-2-methoxy-phenoxy)propanamide
MOLECULAR FORMULA: C18H17F2NO4
MOLECULAR WEIGHT: 349.328686
SMILES: C[C@H](C(=O)NC1=CC(=C(C=C1)F)F)OC2=C(C=C(C=C2)C(=O)C)OC
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Product OPENEYE NAME: [2-(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)-2-oxo-ethyl] 6-methyl-4-oxo-chromene-2-carboxylate
CAS Name: 6-methyl-4-oxo-1-benzopyran-2-carboxylic acid [2-(2,5-dimethyl-1-propan-2-yl-3-pyrrolyl)-2-oxoethyl] ester
IUPAC NAME: [2-(2,5-dimethyl-1-propan-2-ylpyrrol-3-yl)-2-oxoethyl] 6-methyl-4-oxochromene-2-carboxylate
SYSTEMATIC NAME: [2-(2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)-2-oxidanylidene-ethyl] 6-methyl-4-oxidanylidene-chromene-2-carboxylate
MOLECULAR FORMULA: C22H23NO5
MOLECULAR WEIGHT: 381.42172
SMILES: CC1=CC2=C(C=C1)OC(=CC2=O)C(=O)OCC(=O)C3=C(N(C(=C3)C)C(C)C)C
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Product OPENEYE NAME: methyl 5-[[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]furan-2-carboxylate
CAS Name: 5-[[4-(2,4-dimethylphenyl)sulfonyl-1-piperazin-1-iumyl]methyl]-2-furancarboxylic acid methyl ester
IUPAC NAME: methyl 5-[[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]furan-2-carboxylate
SYSTEMATIC NAME: methyl 5-[[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]furan-2-carboxylate
MOLECULAR FORMULA: C19H25N2O5S+
MOLECULAR WEIGHT: 393.4772
SMILES: CC1=CC(=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC3=CC=C(O3)C(=O)OC)C
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